3-Chloro-4-(4-nitrophenoxy)biphenyl
TL;DR: 3-Chloro-4-(4-nitrophenoxy)biphenyl (CAS 6945-85-3) is a chemical compound with molecular formula C18H12ClNO3 and molecular weight 325.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(4-nitrophenoxy)-4-phenylbenzene
Also Known As: 3-chloro-4-(4-nitrophenoxy)biphenyl, 2-chloro-1-(4-nitrophenoxy)-4-phenylbenzene, 3-CHLORO-4-(4-NITROPHENOXY)-1,1'-BIPHENYL, 2-chloro-1-(4-nitrophenoxy)-4-phenyl-benzene
| Molecular Formula | C18H12ClNO3 |
|---|---|
| Molecular Weight | 325.05 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.05057 |
| Heavy Atoms | 23 |
| Complexity | 386.0 |
Chemical Identifiers
| CAS Number | 6945-85-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC(=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-])Cl |
| InChIKey | QBPFRTRISMTXSS-UHFFFAOYSA-N |
Product Overview
3-Chloro-4-(4-nitrophenoxy)biphenyl (CAS 6945-85-3), with molecular formula C18H12ClNO3 and molecular weight 325.05 g/mol. IUPAC: 2-chloro-1-(4-nitrophenoxy)-4-phenylbenzene.
Chemical Property Profile of 3-Chloro-4-(4-nitrophenoxy)biphenyl
Property Insights of 3-Chloro-4-(4-nitrophenoxy)biphenyl
The XLogP value of 5.5 indicates that 3-Chloro-4-(4-nitrophenoxy)biphenyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.1 Ų, 3-Chloro-4-(4-nitrophenoxy)biphenyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-(4-nitrophenoxy)biphenyl has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Chloro-4-(4-nitrophenoxy)biphenyl?
The CAS number of 3-Chloro-4-(4-nitrophenoxy)biphenyl is 6945-85-3.
What is the molecular formula of 3-Chloro-4-(4-nitrophenoxy)biphenyl?
The molecular formula of 3-Chloro-4-(4-nitrophenoxy)biphenyl is C18H12ClNO3.
What is the molecular weight of 3-Chloro-4-(4-nitrophenoxy)biphenyl?
The molecular weight of 3-Chloro-4-(4-nitrophenoxy)biphenyl is 325.05 g/mol.
Where can I buy 3-Chloro-4-(4-nitrophenoxy)biphenyl?
You can request a quote for 3-Chloro-4-(4-nitrophenoxy)biphenyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-(4-nitrophenoxy)biphenyl?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-(4-nitrophenoxy)biphenyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.